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Journal of Computer-Aided Molecular Design|December 1, 1991
A machine learning approach to computer-aided molecular designG Bolis, L Di Pace, F Fabrocini
Journal of Computer-Aided Molecular Design|January 22, 2008
LASSO-ligand activity by surface similarity order: a new tool for ligand based virtual screeningDarryl Reid, Bashir S Sadjad, Zsolt Zsoldos, et al.
Journal of Computer-Aided Molecular Design|January 31, 2008
Homology modeling of 5-lipoxygenase and hints for better inhibitor designP Aparoy, R N Reddy, Lalitha Guruprasad, et al.
Journal of Computer-Aided Molecular Design|April 17, 2008
Fast and accurate methods for predicting short-range constraints in protein modelsDominik Gront, Andrzej Kolinski
Journal of Computer-Aided Molecular Design|October 20, 1998
A branch-and-bound method for optimal atom-type assignment in de novo ligand designN P Todorov, P M Dean
Journal of Computer-Aided Molecular Design|October 20, 1998
Conformational energy penalties of protein-bound ligandsJ Boström, P O Norrby, T Liljefors
Journal of Computer-Aided Molecular Design|October 20, 1998
Comparative molecular field analysis of artemisinin derivatives: ab initio versus semiempirical optimized structuresS Tonmunphean, S Kokpol, V Parasuk, et al.
Journal of Computer-Aided Molecular Design|January 8, 1999
QSAR modeling with the electrotopological state indices: corticosteroidsC de Gregorio, L B Kier, L H Hall
Journal of Computer-Aided Molecular Design|January 8, 1999
A uniform molecular model of delta opioid agonist and antagonist pharmacophore conformationsW Brandt
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